In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 21 | Yes |
Popular Name: (1S)-N-methyl-1-[4-methyl-2-(2-naphthyl)pyrimidin-5-yl]ethanamine (1S)-N-methyl-1-[4-methyl-2-(2-n…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.63 | 9.06 | -47.75 | 2 | 3 | 1 | 42 | 278.379 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.63 | 7.81 | -7.08 | 1 | 3 | 0 | 38 | 277.371 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.